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16182-04-0

Basic Information
CAS No.: 16182-04-0
Name: ETHOXYCARBONYL ISOTHIOCYANATE
Article Data: 56
Molecular Structure:
Molecular Structure of 16182-04-0 (ETHOXYCARBONYL ISOTHIOCYANATE)
Formula: C4H5NO2S
Molecular Weight: 131.155
Synonyms: Carbonicacid, ethyl ester, anhydride with isothiocyanic acid (7CI);Carbonic acid,monoanhydride with isothiocyanic acid, ethyl ester (8CI);Carbethoxyisothiocyanate;Carbonic acid ethyl ester isothiocyanate;Ethoxycarbonyl mustard oil;Ethylisothiocyanatocarbonate;Ethyl isothiocyanatoformate;NSC 158480;
EINECS: 240-318-9
Density: 1.16 g/cm3
Boiling Point: 155.3 °C at 760 mmHg
Flash Point: 50.6 °C
Appearance: light yellow oil
Hazard Symbols: ToxicT, IrritantXi
Risk Codes: 23-36/37/38-42
Safety: 23-26-36/37/39-45
Transport Information: UN 2929 6.1/PG 2
PSA: 70.75000
LogP: 1.24570
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     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86 15889746615

    Address:BuildingA7, KingloryTongxin International Industry Park, Wanglei Avenue, Hi-tec District

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  • ETHOXYCARBONYL ISOTHIOCYANATE

  • Casno:

    16182-04-0

    ETHOXYCARBONYL ISOTHIOCYANATE

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    factory?direct?saleAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:healing drugs Transportation:By sea Port:Shanghai/tianjin

    Zhejiang Jiuzhou Chemical Co.,Ltd is a market-oriented and innovation-driven biopharmaceutical company. The company is focusing on the R&D, manufacturing and sales of pharmaceutica

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  • Ethoxycarbonyl isothiocyanate, 97%

  • Casno:

    16182-04-0

    Ethoxycarbonyl isothiocyanate, 97%

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    in stock Application:16182-04-0

    BeanTown Chemical, with a product range of over 7000 products with about 6000 in stock and ready to ship, is a manufacturer and supplier of research chemicals, metals and materials

  •  Beantown Chemical

    United States  |  Contact Details

    Business Type:Trading Company

    Tel:844-891-6306

    Address:9-11 Sagamore Park Road Hudson NH 03051

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  • Ethoxycarbonyl isothiocyanate

  • Casno:

    16182-04-0

    Ethoxycarbonyl isothiocyanate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Best Seller, High Quality, Competitive Price, Fast Delivery, Quick ResponseAppearance:powder, or liquid Storage:Stored in room temperature, ventilated place Package:Bottle, barrel, cargo, container, etc. Application:Pharmaceuticals, intermediates, AP

  •  LEAP CHEM Co., Ltd.

    China (Mainland)  |  Contact Details

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Specification

The Ethoxycarbonyl isothiocyanate with cas registry number of 16182-04-0 is light yellow oil. It is sensitive to moisture and lachrymatory. This chemical is a kind of miscellaneous reagents. Its IUPAC name is called ethyl N-(sulfanylidenemethylidene)carbamate. And its systematic name is called ethyl carbonisothiocyanatidate. It has an EINECS registry number which is called 240-318-9. It should be stored at temperature of  2-8°C.

The physical properties about this chemical are: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 20.62; (6)ACD/BCF (pH 7.4): 20.62; (7)ACD/KOC (pH 5.5): 303.67; (8)ACD/KOC (pH 7.4): 303.67; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.503; (13)Molar Refractivity: 33.41 cm3; (14)Molar Volume: 112.8 cm3; (15)Surface Tension: 35 dyne/cm; (16)Density: 1.16 g/cm3; (17)Flash Point: 50.6 °C; (18)Enthalpy of Vaporization: 39.2 kJ/mol; (19)Boiling Point: 155.3 °C at 760 mmHg; (20)Vapour Pressure: 3.05 mmHg at 25°C ; (21)Refractive index: 1.500.

When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation which may cause sensitization. It is also irritating to eyes, respiratory system and skin. Therefore, when you are using it, it is better to wear suitable protective clothing, gloves and eye/face protection and do not breathe vapour. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Or if you feel unwell, seek medical advice immediately.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)/N=C=S;
(2)InChI: InChI=1/C4H5NO2S/c1-2-7-4(6)5-3-8/h2H2,1H3;
(3)InChIKey: BDTDECDAHYOJRO-UHFFFAOYAF